data_LACS ################################# # LACS Output Information # ################################# ############################################################ # LACS Designator Definition # # # # Index Value Definition # # # # 0 Outliers # # 1 Normal points # # # ############################################################ save_LACS_CACB_CA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 -2.92 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.83 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.40 _LACS_plot.Line_2_terminator_val_x_2 5.28 _LACS_plot.Line_2_terminator_val_y_2 3.91 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 HIS 2.56 5.17 0 23 HIS 1.58 4.96 0 10 SER 0.99 0.19 1 11 LEU 0.20 -0.30 1 13 ARG 2.59 1.52 1 14 ASP -0.32 -1.76 1 15 ILE -3.68 -2.65 1 16 THR -5.18 -2.42 1 17 ALA 4.78 3.38 1 18 VAL 4.63 3.48 1 19 GLU 2.17 2.63 1 20 LEU 3.21 2.99 1 21 GLN 5.29 3.90 1 22 ASN 3.62 3.06 1 24 PHE 1.92 0.61 1 25 LYS 4.82 3.90 1 26 ASN 3.60 2.28 1 27 SER -0.38 1.51 1 28 SER 1.55 1.05 1 30 ASP 2.59 3.54 1 31 GLN -3.78 -0.40 1 32 ILE -1.85 -0.14 1 33 ARG -2.24 -1.27 1 34 LEU -2.94 -0.44 1 35 ARG -0.67 -2.77 1 36 ALA 4.24 3.58 1 37 ASP 3.62 1.58 1 38 LYS -2.71 -1.32 1 40 ILE -6.88 -2.65 1 41 ALA -7.90 -2.42 1 42 PHE -3.74 -1.68 1 43 LEU -3.09 -2.23 1 44 GLU -4.73 -1.94 1 45 PHE -3.24 -0.89 1 46 ASP -0.79 -0.26 1 47 ALA 1.15 1.66 1 48 ASP 2.26 1.89 1 49 LYS 0.03 0.61 1 50 ASP -1.03 -1.40 1 51 ARG 3.18 2.79 1 52 THR 2.13 1.81 1 54 ILE 3.62 2.23 1 55 GLN 4.99 3.41 1 56 ARG 4.07 2.93 1 57 ARG 4.33 4.34 1 58 MET 4.85 4.12 1 59 ASP 4.59 3.48 1 60 ILE 4.47 3.61 1 61 ALA 5.21 3.52 1 62 LEU 4.15 2.78 1 63 LEU 1.81 1.40 1 64 GLN -0.49 -1.68 1 67 THR -2.87 -0.55 1 68 LEU -2.41 -1.23 1 69 LEU -3.00 -1.16 1 70 LYS 4.69 1.42 1 71 GLU 3.46 1.44 1 72 LYS -3.37 -2.21 1 73 LYS 0.23 -0.11 1 74 ILE -1.26 0.07 1 75 ASN -4.65 -1.77 1 76 VAL -3.05 -0.45 1 77 GLU -6.76 -2.01 1 78 LEU 0.09 0.44 1 79 THR -0.34 0.03 1 80 VAL -0.60 -0.01 1 85 ASN 0.06 -0.13 1 86 SER 1.42 1.28 1 87 GLN 2.41 1.72 1 88 GLU 1.47 1.34 1 89 ARG 2.37 1.63 1 90 LEU 1.97 1.36 1 91 GLU 1.54 1.29 1 92 LYS 1.85 1.36 1 93 LEU 1.09 0.87 1 94 LYS 1.42 1.06 1 95 ASN 0.31 0.59 1 96 LYS 1.29 0.93 1 97 ASN 0.93 0.61 1 98 ILE 1.14 0.96 1 99 LYS 1.17 0.61 1 100 LEU 1.25 0.97 1 101 ASP 1.50 1.26 1 102 GLU 1.87 1.36 1 103 GLU 1.38 1.13 1 104 ARG 2.22 1.58 1 105 LYS 2.00 1.51 1 106 GLU 1.37 1.24 1 107 ARG 2.06 1.39 1 108 LEU 1.37 1.02 1 109 THR 1.67 1.53 1 110 LYS 1.02 0.72 1 111 MET 0.83 0.69 1 112 ILE 0.80 0.62 1 113 ASN 0.51 0.36 1 114 ASP 0.41 0.40 1 116 ASN 0.68 0.46 1 117 GLN 0.91 0.62 1 118 LYS 0.57 0.22 1 119 LYS 0.35 0.05 1 120 ILE -0.12 -0.24 1 121 ALA -0.31 -0.21 1 122 LYS 0.15 0.18 1 123 THR -0.28 -0.16 1 124 THR -0.05 0.00 1 125 ALA -0.02 0.15 1 126 THR -0.05 0.00 1 127 ALA -0.02 -0.05 1 128 ALA 0.00 -0.03 1 129 GLN 0.02 0.13 1 130 THR -0.36 -0.24 1 131 SER -0.29 0.04 1 stop_ save_ save_LACS_CACB_CB_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CB _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 4.98 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -1.17 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.60 _LACS_plot.Line_2_terminator_val_x_2 5.28 _LACS_plot.Line_2_terminator_val_y_2 -1.37 _LACS_plot.Y_axis_chem_shift_offset -0.07 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 65 HIS 2.56 2.61 0 23 HIS 1.58 3.38 0 10 SER 0.99 -0.80 1 11 LEU 0.20 -0.50 1 13 ARG 2.59 -1.07 1 14 ASP -0.32 -1.44 1 15 ILE -3.68 1.03 1 16 THR -5.18 2.76 1 17 ALA 4.78 -1.40 1 18 VAL 4.63 -1.15 1 19 GLU 2.17 0.46 1 20 LEU 3.21 -0.22 1 21 GLN 5.29 -1.39 1 22 ASN 3.62 -0.56 1 24 PHE 1.92 -1.31 1 25 LYS 4.82 -0.92 1 26 ASN 3.60 -1.32 1 27 SER -0.38 1.89 1 28 SER 1.55 -0.50 1 30 ASP 2.59 0.95 1 31 GLN -3.78 3.38 1 32 ILE -1.85 1.71 1 33 ARG -2.24 0.97 1 34 LEU -2.94 2.50 1 35 ARG -0.67 -2.10 1 36 ALA 4.24 -0.66 1 37 ASP 3.62 -2.04 1 38 LYS -2.71 1.39 1 40 ILE -6.88 4.23 1 41 ALA -7.90 5.48 1 42 PHE -3.74 2.06 1 43 LEU -3.09 0.86 1 44 GLU -4.73 2.79 1 45 PHE -3.24 2.35 1 46 ASP -0.79 0.53 1 47 ALA 1.15 0.51 1 48 ASP 2.26 -0.37 1 49 LYS 0.03 0.58 1 50 ASP -1.03 -0.37 1 51 ARG 3.18 -0.39 1 52 THR 2.13 -0.32 1 54 ILE 3.62 -1.39 1 55 GLN 4.99 -1.58 1 56 ARG 4.07 -1.14 1 57 ARG 4.33 0.01 1 58 MET 4.85 -0.73 1 59 ASP 4.59 -1.11 1 60 ILE 4.47 -0.86 1 61 ALA 5.21 -1.69 1 62 LEU 4.15 -1.37 1 63 LEU 1.81 -0.41 1 64 GLN -0.49 -1.19 1 67 THR -2.87 2.32 1 68 LEU -2.41 1.18 1 69 LEU -3.00 1.84 1 70 LYS 4.69 -3.27 1 71 GLU 3.46 -2.02 1 72 LYS -3.37 1.16 1 73 LYS 0.23 -0.34 1 74 ILE -1.26 1.33 1 75 ASN -4.65 2.88 1 76 VAL -3.05 2.60 1 77 GLU -6.76 4.75 1 78 LEU 0.09 0.35 1 79 THR -0.34 0.37 1 80 VAL -0.60 0.59 1 85 ASN 0.06 -0.19 1 86 SER 1.42 -0.14 1 87 GLN 2.41 -0.69 1 88 GLU 1.47 -0.13 1 89 ARG 2.37 -0.74 1 90 LEU 1.97 -0.61 1 91 GLU 1.54 -0.25 1 92 LYS 1.85 -0.49 1 93 LEU 1.09 -0.22 1 94 LYS 1.42 -0.36 1 95 ASN 0.31 0.28 1 96 LYS 1.29 -0.36 1 97 ASN 0.93 -0.32 1 98 ILE 1.14 -0.18 1 99 LYS 1.17 -0.56 1 100 LEU 1.25 -0.28 1 101 ASP 1.50 -0.24 1 102 GLU 1.87 -0.51 1 103 GLU 1.38 -0.25 1 104 ARG 2.22 -0.64 1 105 LYS 2.00 -0.49 1 106 GLU 1.37 -0.13 1 107 ARG 2.06 -0.67 1 108 LEU 1.37 -0.35 1 109 THR 1.67 -0.14 1 110 LYS 1.02 -0.30 1 111 MET 0.83 -0.14 1 112 ILE 0.80 -0.18 1 113 ASN 0.51 -0.15 1 114 ASP 0.41 -0.01 1 116 ASN 0.68 -0.22 1 117 GLN 0.91 -0.29 1 118 LYS 0.57 -0.35 1 119 LYS 0.35 -0.30 1 120 ILE -0.12 -0.12 1 121 ALA -0.31 0.10 1 122 LYS 0.15 0.03 1 123 THR -0.28 0.12 1 124 THR -0.05 0.05 1 125 ALA -0.02 0.17 1 126 THR -0.05 0.05 1 127 ALA -0.02 -0.03 1 128 ALA 0.00 -0.03 1 129 GLN 0.02 0.11 1 130 THR -0.36 0.12 1 131 SER -0.29 0.33 1 stop_ save_ save_LACS_CACB_HA_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name HA _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 0.64 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 -0.15 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 0.21 _LACS_plot.Line_2_terminator_val_x_2 5.28 _LACS_plot.Line_2_terminator_val_y_2 -0.46 _LACS_plot.Y_axis_chem_shift_offset -0.02 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 76 VAL -3.05 1.23 0 10 SER 0.99 -0.49 1 11 LEU 0.20 -0.54 1 13 ARG 2.59 -0.13 1 14 ASP -0.32 -0.05 1 15 ILE -3.68 0.15 1 16 THR -5.18 0.43 1 17 ALA 4.78 -0.43 1 18 VAL 4.63 -0.30 1 19 GLU 2.17 -0.27 1 20 LEU 3.21 -0.15 1 21 GLN 5.29 -0.63 1 22 ASN 3.62 -0.23 1 23 HIS 1.58 -0.51 1 24 PHE 1.92 0.04 1 25 LYS 4.82 -0.10 1 26 ASN 3.60 -0.07 1 27 SER -0.38 -0.01 1 28 SER 1.55 -0.64 1 30 ASP 2.59 -0.27 1 31 GLN -3.78 0.11 1 32 ILE -1.85 0.49 1 33 ARG -2.24 0.40 1 34 LEU -2.94 0.20 1 35 ARG -0.67 0.50 1 36 ALA 4.24 -0.49 1 37 ASP 3.62 -0.30 1 38 LYS -2.71 0.23 1 40 ILE -6.88 1.11 1 41 ALA -7.90 0.53 1 42 PHE -3.74 0.67 1 43 LEU -3.09 0.45 1 44 GLU -4.73 0.92 1 45 PHE -3.24 0.29 1 46 ASP -0.79 0.14 1 47 ALA 1.15 -0.18 1 48 ASP 2.26 -0.07 1 49 LYS 0.03 -0.04 1 50 ASP -1.03 0.20 1 51 ARG 3.18 -0.07 1 52 THR 2.13 0.03 1 54 ILE 3.62 -0.26 1 55 GLN 4.99 -0.64 1 56 ARG 4.07 -0.25 1 57 ARG 4.33 -0.58 1 58 MET 4.85 -1.19 1 59 ASP 4.59 -0.33 1 60 ILE 4.47 -0.46 1 61 ALA 5.21 0.06 1 62 LEU 4.15 -0.31 1 63 LEU 1.81 -0.02 1 64 GLN -0.49 0.35 1 65 HIS 2.56 -0.43 1 67 THR -2.87 0.01 1 68 LEU -2.41 0.49 1 69 LEU -3.00 -0.06 1 70 LYS 4.69 -0.59 1 71 GLU 3.46 -0.62 1 72 LYS -3.37 0.22 1 73 LYS 0.23 0.25 1 74 ILE -1.26 0.48 1 75 ASN -4.65 1.06 1 77 GLU -6.76 0.39 1 78 LEU 0.09 0.28 1 79 THR -0.34 0.24 1 80 VAL -0.60 0.13 1 85 ASN 0.06 0.01 1 86 SER 1.42 -0.17 1 87 GLN 2.41 -0.20 1 88 GLU 1.47 -0.20 1 89 ARG 2.37 -0.17 1 90 LEU 1.97 -0.16 1 91 GLU 1.54 -0.22 1 92 LYS 1.85 -0.12 1 93 LEU 1.09 -0.12 1 94 LYS 1.42 -0.12 1 95 ASN 0.31 -0.08 1 96 LYS 1.29 -0.06 1 97 ASN 0.93 -0.04 1 98 ILE 1.14 -0.07 1 99 LYS 1.17 -0.02 1 100 LEU 1.25 -0.08 1 101 ASP 1.50 -0.12 1 102 GLU 1.87 -0.20 1 103 GLU 1.38 -0.18 1 104 ARG 2.22 -0.16 1 105 LYS 2.00 -0.16 1 106 GLU 1.37 -0.17 1 107 ARG 2.06 -0.13 1 108 LEU 1.37 0.00 1 109 THR 1.67 -0.16 1 110 LYS 1.02 -0.03 1 111 MET 0.83 -0.05 1 112 ILE 0.80 -0.09 1 113 ASN 0.51 0.00 1 114 ASP 0.41 -0.09 1 116 ASN 0.68 -0.02 1 117 GLN 0.91 -0.06 1 118 LYS 0.57 -0.05 1 119 LYS 0.35 0.00 1 120 ILE -0.12 -0.02 1 121 ALA -0.31 0.02 1 122 LYS 0.15 0.04 1 123 THR -0.28 0.06 1 124 THR -0.05 -0.01 1 125 ALA -0.02 0.08 1 126 THR -0.05 -0.05 1 127 ALA -0.02 -0.01 1 128 ALA 0.00 -0.01 1 129 GLN 0.02 0.07 1 130 THR -0.36 0.03 1 131 SER -0.29 0.05 1 stop_ save_ save_LACS_CACB_CO_output _LACS_plot.Sf_category LACS_output _LACS.plot.Input_file_name bmr19098_21.str _LACS_plot.X_coord_name CA-CB _LACS_plot.Y_coord_name CO _LACS_plot.Line_1_terminator_val_x_1 -7.90 _LACS_plot.Line_1_terminator_val_y_1 -3.81 _LACS_plot.Line_1_terminator_val_x_2 2.00 _LACS_plot.Line_1_terminator_val_y_2 0.81 _LACS_plot.Line_2_terminator_val_x_1 -2.00 _LACS_plot.Line_2_terminator_val_y_1 -1.10 _LACS_plot.Line_2_terminator_val_x_2 5.28 _LACS_plot.Line_2_terminator_val_y_2 2.40 _LACS_plot.Y_axis_chem_shift_offset 0.13 loop_ _LACS.Comp_index_ID _LACS.Comp_ID _LACS.X_coord_val _LACS.Y_coord_val _LACS.Designator 19 GLU 2.17 4.14 0 16 THR -5.18 0.84 0 10 SER 0.99 -0.49 1 11 LEU 0.20 -0.30 1 13 ARG 2.59 -0.15 1 14 ASP -0.32 -0.21 1 15 ILE -3.68 -4.05 1 17 ALA 4.78 2.12 1 18 VAL 4.63 1.79 1 20 LEU 3.21 0.28 1 21 GLN 5.29 2.67 1 22 ASN 3.62 3.01 1 23 HIS 1.58 2.92 1 24 PHE 1.92 0.89 1 25 LYS 4.82 1.73 1 26 ASN 3.60 0.38 1 27 SER -0.38 -1.09 1 30 ASP 2.59 0.01 1 31 GLN -3.78 -2.35 1 32 ILE -1.85 -1.25 1 33 ARG -2.24 -1.98 1 34 LEU -2.94 -1.84 1 35 ARG -0.67 0.00 1 36 ALA 4.24 1.07 1 37 ASP 3.62 0.79 1 38 LYS -2.71 0.03 1 40 ILE -6.88 -2.96 1 41 ALA -7.90 -4.41 1 42 PHE -3.74 -1.14 1 43 LEU -3.09 -2.65 1 44 GLU -4.73 -1.59 1 45 PHE -3.24 -1.30 1 46 ASP -0.79 0.38 1 47 ALA 1.15 0.26 1 48 ASP 2.26 1.54 1 49 LYS 0.03 -0.51 1 50 ASP -1.03 -1.42 1 51 ARG 3.18 2.87 1 52 THR 2.13 1.68 1 54 ILE 3.62 -0.71 1 55 GLN 4.99 1.38 1 56 ARG 4.07 2.44 1 57 ARG 4.33 2.27 1 58 MET 4.85 1.38 1 59 ASP 4.59 3.23 1 60 ILE 4.47 2.58 1 61 ALA 5.21 2.35 1 62 LEU 4.15 3.06 1 63 LEU 1.81 0.02 1 64 GLN -0.49 1.76 1 65 HIS 2.56 2.60 1 67 THR -2.87 -2.46 1 68 LEU -2.41 -1.06 1 69 LEU -3.00 -2.95 1 70 LYS 4.69 -0.98 1 71 GLU 3.46 -1.53 1 72 LYS -3.37 -2.20 1 73 LYS 0.23 0.33 1 74 ILE -1.26 -0.98 1 75 ASN -4.65 -0.93 1 76 VAL -3.05 -1.53 1 77 GLU -6.76 -2.07 1 78 LEU 0.09 -0.57 1 79 THR -0.34 -0.50 1 80 VAL -0.60 0.04 1 85 ASN 0.06 0.45 1 86 SER 1.42 0.59 1 87 GLN 2.41 1.00 1 88 GLU 1.47 1.06 1 89 ARG 2.37 1.20 1 90 LEU 1.97 0.89 1 91 GLU 1.54 1.03 1 92 LYS 1.85 1.11 1 93 LEU 1.09 0.27 1 94 LYS 1.42 0.34 1 95 ASN 0.31 0.44 1 96 LYS 1.29 -0.06 1 97 ASN 0.93 0.31 1 98 ILE 1.14 0.03 1 99 LYS 1.17 0.52 1 100 LEU 1.25 0.35 1 101 ASP 1.50 0.97 1 102 GLU 1.87 1.00 1 103 GLU 1.38 0.99 1 104 ARG 2.22 1.01 1 105 LYS 2.00 1.15 1 106 GLU 1.37 0.71 1 107 ARG 2.06 0.94 1 108 LEU 1.37 0.52 1 109 THR 1.67 0.15 1 110 LYS 1.02 0.06 1 111 MET 0.83 0.43 1 112 ILE 0.80 -0.07 1 113 ASN 0.51 0.04 1 114 ASP 0.41 0.90 1 116 ASN 0.68 0.45 1 117 GLN 0.91 0.17 1 118 LYS 0.57 -0.08 1 119 LYS 0.35 -0.15 1 120 ILE -0.12 -0.46 1 121 ALA -0.31 -0.29 1 122 LYS 0.15 0.24 1 123 THR -0.28 -0.06 1 124 THR -0.05 -0.40 1 125 ALA -0.02 0.14 1 126 THR -0.05 -0.26 1 127 ALA -0.02 -0.35 1 128 ALA 0.00 -0.03 1 129 GLN 0.02 0.28 1 130 THR -0.36 -0.25 1 131 SER -0.29 -0.74 1 stop_ save_